5-isoquinolin-5-ylpyridin-3-ol

C14H10N2O — CID 83130626

IUPAC5-isoquinolin-5-ylpyridin-3-ol
SMILESOc1cncc(-c2cccc3cnccc23)c1
InChIInChI=1S/C14H10N2O/c17-12-6-11(8-16-9-12)13-3-1-2-10-7-15-5-4-14(10)13/h1-9,17H
InChIKeyLOTCHFHUXPOAQN-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.00
Rot. Bonds1

About 5-isoquinolin-5-ylpyridin-3-ol

5-isoquinolin-5-ylpyridin-3-ol (PubChem CID 83130626) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 5-isoquinolin-5-ylpyridin-3-ol.

Molecular Properties

Compound Name5-isoquinolin-5-ylpyridin-3-ol
PubChem CID83130626
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name5-isoquinolin-5-ylpyridin-3-ol
SMILESOc1cncc(-c2cccc3cnccc23)c1
InChIInChI=1S/C14H10N2O/c17-12-6-11(8-16-9-12)13-3-1-2-10-7-15-5-4-14(10)13/h1-9,17H
InChIKeyLOTCHFHUXPOAQN-UHFFFAOYSA-N
XLogP3.00
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-isoquinolin-5-ylpyridin-3-ol?
The IUPAC name of 5-isoquinolin-5-ylpyridin-3-ol (CID 83130626) is 5-isoquinolin-5-ylpyridin-3-ol.
What is the SMILES notation for 5-isoquinolin-5-ylpyridin-3-ol?
The canonical SMILES for 5-isoquinolin-5-ylpyridin-3-ol is Oc1cncc(-c2cccc3cnccc23)c1.
What is the InChIKey of 5-isoquinolin-5-ylpyridin-3-ol?
The InChIKey is LOTCHFHUXPOAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c17-12-6-11(8-16-9-12)13-3-1-2-10-7-15-5-4-14(10)13/h1-9,17H.
What are the key properties of 5-isoquinolin-5-ylpyridin-3-ol?
5-isoquinolin-5-ylpyridin-3-ol has a molecular weight of 222.25 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-isoquinolin-5-ylpyridin-3-ol is sourced from PubChem (CID 83130626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).